- InChI
- InChI=1S/C24H36O4/c1-5-6-7-8-16-27-22(25)18-10-9-11-19(17-18)23(26)28-21-14-12-20(13-15-21)24(2,3)4/h9-11,17,20-21H,5-8,12-16H2,1-4H3
- InChI Key
- OFGIUXAZAVUZFD-UHFFFAOYSA-N
- Formula
- C24H36O4
- SMILES
-
CCCCCCOC(=O)c1cccc(C(=O)OC2CCC
(C(C)(C)C)CC2)c1 - Molecular Weight1
- 388.54
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -194.28 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -778.00 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.09 | kJ/mol | Joback Calculated Property |
| log10WS | -7.34 | Crippen Calculated Property | |
| logPoct/wat | 6.185 | Crippen Calculated Property | |
| McVol | 329.280 | ml/mol | McGowan Calculated Property |
| Pc | 1170.42 | kPa | Joback Calculated Property |
| Inp | [2916.00; 2916.00] |
|
|
| Inp | 2916.00 | NIST | |
| Inp | 2916.00 | NIST | |
| Tboil | 944.41 | K | Joback Calculated Property |
| Tc | 1167.67 | K | Joback Calculated Property |
| Tfus | 549.06 | K | Joback Calculated Property |
| Vc | 1.240 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1119.09; 1198.92] | J/mol×K | [944.41; 1167.67] |
|
| Cp,gas | 1119.09 | J/mol×K | 944.41 | Joback Calculated Property |
| Cp,gas | 1136.30 | J/mol×K | 981.62 | Joback Calculated Property |
| Cp,gas | 1151.86 | J/mol×K | 1018.83 | Joback Calculated Property |
| Cp,gas | 1165.84 | J/mol×K | 1056.04 | Joback Calculated Property |
| Cp,gas | 1178.30 | J/mol×K | 1093.25 | Joback Calculated Property |
| Cp,gas | 1189.31 | J/mol×K | 1130.46 | Joback Calculated Property |
| Cp,gas | 1198.92 | J/mol×K | 1167.67 | Joback Calculated Property |
| η | [0.0000322; 0.0004325] | Pa×s | [549.06; 944.41] |
|
| η | 0.0004325 | Pa×s | 549.06 | Joback Calculated Property |
| η | 0.0002225 | Pa×s | 614.95 | Joback Calculated Property |
| η | 0.0001302 | Pa×s | 680.84 | Joback Calculated Property |
| η | 0.0000837 | Pa×s | 746.73 | Joback Calculated Property |
| η | 0.0000578 | Pa×s | 812.63 | Joback Calculated Property |
| η | 0.0000422 | Pa×s | 878.52 | Joback Calculated Property |
| η | 0.0000322 | Pa×s | 944.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, hexyl 4-tert-butylcyclohexyl ester.
Sources
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